SCHEMBL8906508

SCHEMBL8906508

CCCCc1cccc(COP(=O)(OCc2cccc(CCCC)c2CCCC)OCc2cccc(CCCC)c2CCCC)c1CCCC

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.36
ALOX5 P09917 1/20 0.36
PTGS2 P35354 1/20 0.36
PPARA Q07869 1/20 0.35
BID P55957 1/20 0.35
BCL2L1 Q07817 1/20 0.35
MCL1 Q07820 1/20 0.35
BAK1 Q16611 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8435974 0.85 TSHR (0.42) CYP3A4TSHR
SCHEMBL819273 0.80 LIPG (0.45) CYP3A4ALOX5PTGS2PPARABID
Ammonia Solution, Strong SCHEMBL9810933 0.78 LIPG (0.44) CYP3A4ALOX5PTGS2PPARABID
Water SCHEMBL27341058 0.78 LIPG (0.44) CYP3A4ALOX5PTGS2PPARABID
SCHEMBL706930 0.78 PTGS2 (0.39) CYP3A4ALOX5PTGS2PPARABID
SCHEMBL4381930 0.78 GABRA1 (0.39) TSHR
SCHEMBL385367 0.77 ALOX5 (0.43) TSHRALOX5PTGS2PPARABID
SCHEMBL9444027 0.77 ALOX5 (0.54) CYP3A4TSHRALOX5PTGS2PPARA
SCHEMBL28355115 0.77 LIPG (0.42) CYP3A4ALOX5PTGS2PPARABID
SCHEMBL18241881 0.75 BID (0.40) CYP3A4ALOX5PTGS2PPARABID

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5610443-A Method for encapsulating a semiconductor utilizing an epoxy resin and an onium salt compound GENERAL INSTRUMENT OF TAIWAN, LTD. (TW) 1997-03-11 US disclosed